10-(4-thiophen-2-ylphenyl)phenothiazine

C22H15NS2 — CID 142724599

IUPAC10-(4-thiophen-2-ylphenyl)phenothiazine
SMILESc1csc(-c2ccc(N3c4ccccc4Sc4ccccc43)cc2)c1
InChIInChI=1S/C22H15NS2/c1-3-8-21-18(6-1)23(19-7-2-4-9-22(19)25-21)17-13-11-16(12-14-17)20-10-5-15-24-20/h1-15H
InChIKeyNCCPHOHTKMZBPF-UHFFFAOYSA-N
MW357.50 g/mol
LogP7.35
Rot. Bonds2

About 10-(4-thiophen-2-ylphenyl)phenothiazine

10-(4-thiophen-2-ylphenyl)phenothiazine (PubChem CID 142724599) has the molecular formula C22H15NS2 and a molecular weight of 357.50 g/mol. Its IUPAC name is 10-(4-thiophen-2-ylphenyl)phenothiazine.

Molecular Properties

Compound Name10-(4-thiophen-2-ylphenyl)phenothiazine
PubChem CID142724599
Molecular FormulaC22H15NS2
Molecular Weight357.50 g/mol
Exact Mass357.06
IUPAC Name10-(4-thiophen-2-ylphenyl)phenothiazine
SMILESc1csc(-c2ccc(N3c4ccccc4Sc4ccccc43)cc2)c1
InChIInChI=1S/C22H15NS2/c1-3-8-21-18(6-1)23(19-7-2-4-9-22(19)25-21)17-13-11-16(12-14-17)20-10-5-15-24-20/h1-15H
InChIKeyNCCPHOHTKMZBPF-UHFFFAOYSA-N
XLogP7.35
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.50
LogP ≤ 57.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

10-(6-phenothiazin-10-ylnaphthalen-2-yl)phenothiazine
CID 141449755
N,N-dimethyl-4-phenothiazin-10-ylaniline
CID 149200025
10-[4-[4-[3-(4-phenothiazin-10-ylphenyl)-4-pyridinyl]-3-pyridinyl]phenyl]phenothiazine
CID 122433873
10-[4-[5-(4-phenothiazin-10-ylphenyl)benzo[g]quinoxalin-10-yl]phenyl]phenothiazine
CID 138493324
10-[4-[6-(4-phenothiazin-10-ylphenyl)-9-phenylcarbazol-3-yl]phenyl]phenothiazine
CID 137467162
perchloric acid;10-phenylphenothiazine
CID 71365783
2,2'-bis(4-phenothiazin-10-ylphenyl)-5,5'-spirobi[dibenzothiophene] 5-oxide
CID 155772051
10-(4-quinazolin-2-ylphenyl)phenothiazine
CID 130396246
N,N-diethyl-4-phenothiazin-10-ylaniline
CID 86145082
10-[4-[4-(4,6-diphenylpyrimidin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenothiazine;10-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenothiazine;10-[4-[4-phenyl-6-(6-phenyl-2-pyridinyl)-1,3,5-triazin-2-yl]phenyl]phenothiazine
CID 158949538
10-(4-butylphenyl)phenothiazine
CID 22381652
2-[3,5-di(phenothiazin-10-yl)phenyl]isoindole-1,3-dione
CID 130395529

Frequently Asked Questions

What is the IUPAC name of 10-(4-thiophen-2-ylphenyl)phenothiazine?
The IUPAC name of 10-(4-thiophen-2-ylphenyl)phenothiazine (CID 142724599) is 10-(4-thiophen-2-ylphenyl)phenothiazine.
What is the SMILES notation for 10-(4-thiophen-2-ylphenyl)phenothiazine?
The canonical SMILES for 10-(4-thiophen-2-ylphenyl)phenothiazine is c1csc(-c2ccc(N3c4ccccc4Sc4ccccc43)cc2)c1.
What is the InChIKey of 10-(4-thiophen-2-ylphenyl)phenothiazine?
The InChIKey is NCCPHOHTKMZBPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15NS2/c1-3-8-21-18(6-1)23(19-7-2-4-9-22(19)25-21)17-13-11-16(12-14-17)20-10-5-15-24-20/h1-15H.
What are the key properties of 10-(4-thiophen-2-ylphenyl)phenothiazine?
10-(4-thiophen-2-ylphenyl)phenothiazine has a molecular weight of 357.50 g/mol, XLogP of 7.35, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(4-thiophen-2-ylphenyl)phenothiazine is sourced from PubChem (CID 142724599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).